6-methyl-N-[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: 6-methyl-N-[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: 6-methyl-N-[1-(m-tolylmethyl)-1,2,4-triazol-3-yl]-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: 6-methyl-N-[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: 6-methyl-N-[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: 6-methyl-N-[1-(3-methylbenzyl)-1,2,4-triazol-3-yl]-2-(3-pyridyl)cinchoninamide Formula: C26H22N6O MolecularWeight: 434.49248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=NC(=N2)NC(=O)C3=CC(=NC4=C3C=C(C=C4)C)C5=CN=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=NC(=N2)NC(=O)C3=CC(=NC4=C3C=C(C=C4)C)C5=CN=CC=C5

InChI

InChI=1S/C26H22N6O/c1-17-5-3-6-19(11-17)15-32-16-28-26(31-32)30-25(33)22-13-24(20-7-4-10-27-14-20)29-23-9-8-18(2)12-21(22)23/h3-14,16H,15H2,1-2H3,(H,30,31,33)